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Hopenyl 3.beta.-O-palmitate
SpectraBase Compound ID DarGyDejkj
InChI InChI=1S/C46H80O2/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-41(47)48-40-29-31-44(7)37(42(40,4)5)28-33-46(9)39(44)25-24-38-43(6)30-26-35(34(2)3)36(43)27-32-45(38,46)8/h35-40H,2,10-33H2,1,3-9H3/t35-,36?,37?,38?,39?,40+,43+,44+,45-,46-/m1/s1
InChIKey HABFHSNAEWDJCC-BBKWEYAASA-N
Mol Weight 665.1 g/mol
Molecular Formula C46H80O2
Exact Mass 664.615832 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IzcRAeXvugj
Name HOPENYL-3-BETA-O-PALMITATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H80O2
InChI InChI=1S/C46H80O2/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-41(47)48-40-29-31-44(7)37(42(40,4)5)28-33-46(9)39(44)25-24-38-43(6)30-26-35(34(2)3)36(43)27-32-45(38,46)8/h35-40H,2,10-33H2,1,3-9H3/t35-,36?,37?,38?,39?,40+,43+,44+,45-,46-/m1/s1
InChIKey HABFHSNAEWDJCC-BBKWEYAASA-N
Literature Reference Author V.S.P.CHATURVEDULA,J.K.SCHILLING,J.S.MILLER,R.ANDRIANTSIFERA NA,V.E.RASAMISON,D.G
Literature Reference Citation J.NAT.PROD.,65,1222(2002)
Literature Reference DOI 10.1021/np0201220
Molecular Weight 665.140 g/mol
Solvent CDCl3
Source File Reference UWSI6348